pentadecafluoro-1-isocyanatoadamantane | 917482-40-7

• 分子结构分类: 有机化合物 - 有机氮化合物
• 英文名称: pentadecafluoro-1-isocyanatoadamantane
• 英文别名: 1,2,2,3,4,4,5,6,6,8,8,9,9,10,10-Pentadecafluoro-7-isocyanatoadamantane；1,2,2,3,4,4,5,6,6,8,8,9,9,10,10-pentadecafluoro-7-isocyanatoadamantane
• CAS: 917482-40-7
• 化学式: C₁₁F₁₅NO
• 分子量: 447.103
• InChiKey: TWAKNZGHLJGWTK-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.9
• 重原子数：
  28
• 可旋转键数：
  1
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.91
• 拓扑面积：
  29.4
• 氢给体数：
  0
• 氢受体数：
  17

反应信息

• 作为反应物：
  描述：

  pentadecafluoro-1-isocyanatoadamantane 在 水 作用下， 以 四氢呋喃 为溶剂， 反应 5.5h， 以90%的产率得到pentadecafluoro-1-adamantylamine
  参考文献：
  名称：

  Functional group transformation of perfluoroadamantane derivatives

  摘要：

  An adarnantane skeleton, having rigid structure, has been used for a thermally stable and/or anti-etching material. It is expected to be a material having good optical properties, if fluorine atoms are introduced into the skeleton. Thus, the investigation concerning the functional group transformation of perfluoroadamantanecarboxylic acid derivatives was performed to develop the methods for introduction of perfluoroadamantyl group into molecules. Their unique reactivities are also discussed. (c) 2006 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.jfluchem.2006.06.001
• 作为产物：
  描述：

  反应 1.0h， 以15.7 g的产率得到pentadecafluoro-1-isocyanatoadamantane
  参考文献：
  名称：

  Functional group transformation of perfluoroadamantane derivatives

  摘要：

  An adarnantane skeleton, having rigid structure, has been used for a thermally stable and/or anti-etching material. It is expected to be a material having good optical properties, if fluorine atoms are introduced into the skeleton. Thus, the investigation concerning the functional group transformation of perfluoroadamantanecarboxylic acid derivatives was performed to develop the methods for introduction of perfluoroadamantyl group into molecules. Their unique reactivities are also discussed. (c) 2006 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.jfluchem.2006.06.001

文献信息

• Functional group transformation of perfluoroadamantane derivatives
  作者：Koichi Murata、Shu-Zhong Wang、Yoshitomi Morizawa、Kazuya Oharu

  DOI：10.1016/j.jfluchem.2006.06.001

  日期：2006.8

  An adarnantane skeleton, having rigid structure, has been used for a thermally stable and/or anti-etching material. It is expected to be a material having good optical properties, if fluorine atoms are introduced into the skeleton. Thus, the investigation concerning the functional group transformation of perfluoroadamantanecarboxylic acid derivatives was performed to develop the methods for introduction of perfluoroadamantyl group into molecules. Their unique reactivities are also discussed. (c) 2006 Elsevier B.V. All rights reserved.